nuclear magnetic resonance spectroscopy (NMR)
URL: https://www.chemotion-repository.net/inchikey/HXLBNGXQOHGOFK-UHFFFAOYSA-N/CHMO0000591
Dataset description:
dataset for nuclear magnetic resonance spectroscopy (NMR)\n\n
Chemical Info
| InChI | InChI=1S/C47H40N4/c1-47(2,3)38-29-37-22-20-32-16-14-31(15-17-32)18-19-33-21-27-40-41(30-38)43(37)51(42(40)28-33)39-25-23-36(24-26-39)46-49-44(34-10-6-4-7-11-34)48-45(50-46)35-12-8-5-9-13-35/h4-17,21,23-30H,18-20,22H2,1-3H3 |
|---|---|
| SMILES | CC(c1cc2CCc3ccc(cc3)CCc3ccc4c(c1)c2n(c4c3)c1ccc(cc1)c1nc(nc(n1)c1ccccc1)c1ccccc1)(C)C |
| InChI Key | HXLBNGXQOHGOFK-UHFFFAOYSA-N |
| Exact Mass | 660.847 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 54f624a2-037a-4e44-ad81-8b8aaeef7413 |
| Package id | 10-14272-hxlbngxqohgofk-uhfffaoysa-n-chmo0000591 |
| Resource type | HTML |
| State | active |